diff --git a/parser/parser-vasp/vaspparser/parser_vasprun.py b/parser/parser-vasp/vaspparser/parser_vasprun.py index 6aa9f88149f4e71eaf8f8db811c09ba5d5044a8d..02e5117ae6b81404476304ac122735fd189fecb7 100644 --- a/parser/parser-vasp/vaspparser/parser_vasprun.py +++ b/parser/parser-vasp/vaspparser/parser_vasprun.py @@ -806,9 +806,10 @@ class VasprunContext(object): # states/eV/cell. This means that the volume # dependence has been introduced by multiplying # by the cell volume + # the integrated dos value is the number of electrons until that energy level + # and thus not directly energy dependent anymore joule_in_ev = convert_unit(1, "eV", "J") dosV = dosV / joule_in_ev - dosI = dosI / joule_in_ev if self.vbTopE: eRef = max(self.vbTopE)